dicyclopropylmethylidenecyclopentane

C12H17+ — CID 102093708

IUPACdicyclopropylmethylidenecyclopentane
SMILES[CH+]1CCCC1=C(C1CC1)C1CC1
InChIInChI=1S/C12H17/c1-2-4-9(3-1)12(10-5-6-10)11-7-8-11/h3,10-11H,1-2,4-8H2/q+1
InChIKeyANXBUVATLAVASB-UHFFFAOYSA-N
MW161.27 g/mol
LogP3.49
Rot. Bonds2

About dicyclopropylmethylidenecyclopentane

dicyclopropylmethylidenecyclopentane (PubChem CID 102093708) has the molecular formula C12H17+ and a molecular weight of 161.27 g/mol. Its IUPAC name is dicyclopropylmethylidenecyclopentane.

Molecular Properties

Compound Namedicyclopropylmethylidenecyclopentane
PubChem CID102093708
Molecular FormulaC12H17+
Molecular Weight161.27 g/mol
Exact Mass161.13
IUPAC Namedicyclopropylmethylidenecyclopentane
SMILES[CH+]1CCCC1=C(C1CC1)C1CC1
InChIInChI=1S/C12H17/c1-2-4-9(3-1)12(10-5-6-10)11-7-8-11/h3,10-11H,1-2,4-8H2/q+1
InChIKeyANXBUVATLAVASB-UHFFFAOYSA-N
XLogP3.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.27
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

Cyclopropane, 1,1',1''-(1-ethenyl-2-ylidene)tris-
CID 141044
1,2,2-Tricyclopropylethenylcyclopropane
CID 11286934
Dicyclopropylmethylidenecyclopropane
CID 640658
1,2-Dicyclopropylcyclopropene
CID 129652612
n-Butylbicyclopro-pylidene
CID 129653472
(2Z)-1-butyl-2-(2-butylcyclopropylidene)cyclopropane
CID 134993655
Cyclopropane, 1,1'-(2-methyl-1-propenylidene)bis-
CID 141372
1-(1-Cyclopropylideneethyl)-2-ethylcyclopropane
CID 91396843
3-Cyclopropylhexan-2-ylidenecyclopentane
CID 123813212
Tricyclo[4.1.0.02,4]hept-1-ene
CID 148981974
1-Cyclopropyl-2-(2-methylcyclopropyl)cyclopentene
CID 163952300
1,1'-[3-Methyl-2-(propan-2-yl)but-1-ene-1,1-diyl]dicyclopropane
CID 12429534

Frequently Asked Questions

What is the IUPAC name of dicyclopropylmethylidenecyclopentane?
The IUPAC name of dicyclopropylmethylidenecyclopentane (CID 102093708) is dicyclopropylmethylidenecyclopentane.
What is the SMILES notation for dicyclopropylmethylidenecyclopentane?
The canonical SMILES for dicyclopropylmethylidenecyclopentane is [CH+]1CCCC1=C(C1CC1)C1CC1.
What is the InChIKey of dicyclopropylmethylidenecyclopentane?
The InChIKey is ANXBUVATLAVASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17/c1-2-4-9(3-1)12(10-5-6-10)11-7-8-11/h3,10-11H,1-2,4-8H2/q+1.
What are the key properties of dicyclopropylmethylidenecyclopentane?
dicyclopropylmethylidenecyclopentane has a molecular weight of 161.27 g/mol, XLogP of 3.49, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dicyclopropylmethylidenecyclopentane is sourced from PubChem (CID 102093708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).